General Information of the Compound
Compound ID
CP0429542
Compound Name
N-(2,6-diphenylimidazo[1,2-a]pyrazin-8-yl)thiophene-2-carboxamide
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Structure
Formula
C23H16N4OS
Molecular Weight
396.475
Canonical SMILES
O=C(Nc1nc(cn2cc(nc12)-c1ccccc1)-c1ccccc1)c1cccs1
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InChI
InChI=1S/C23H16N4OS/c28-23(20-12-7-13-29-20)26-21-22-25-19(17-10-5-2-6-11-17)15-27(22)14-18(24-21)16-8-3-1-4-9-16/h1-15H,(H,24,26,28)
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InChIKey
NGCYWJLJMSTZKR-UHFFFAOYSA-N
Physicochemical Property
logP
5.3771
Rotatable Bonds
4
Heavy Atom Count
29
Polar Areas
59.29
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
29

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 137647217
ChEMBL ID
CHEMBL4082842
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT05120, Transmembrane domain-containing protein TMIGD3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
Ki = 185 nM
   TI
   LI
   LO
   TS